SCHEMBL439502

SCHEMBL439502

CC1CCC(CN=C=O)C2C3CC(CC3CN=C=O)C12

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL672876 0.94
SCHEMBL1900904 0.82
SCHEMBL1901687 0.82
SCHEMBL11026717 0.76
SCHEMBL8037145 0.70
SCHEMBL8512400 0.70 TSHR (0.32)
SCHEMBL2330759 0.69
SCHEMBL29039916 0.69
SCHEMBL19021594 0.69
SCHEMBL19107425 0.69

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 156 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3094661-B1 COMPOSITIONS WITH ENHANCED FLEXIBILITY MOMENTIVE PERFORMANCE MAT INC (US) 2019-06-19 EP claimed
US-9890303-B2 Compositions with enhanced flexibility MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2018-02-13 US claimed
US-20170283544-A1 COMPOSITIONS WITH ENHANCED FLEXIBILITY MOMENTIVE PERFORMANCE MATERIALS INC. 2017-10-05 US claimed
US-9718995-B2 Compositions with enhanced flexibility MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2017-08-01 US claimed
EP-3094661-A1 COMPOSITIONS WITH ENHANCED FLEXIBILITY Momentive Performance Materials Inc. (US) 2016-11-23 EP claimed
US-20150203724-A1 COMPOSITIONS WITH ENHANCED FLEXIBILITY MOMENTIVE PERFORMANCE MATERIALS INC. 2015-07-23 US claimed
WO-2015108905-A1 COMPOSITIONS WITH ENHANCED FLEXIBILITY MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2015-07-23 WO claimed
EP-1669385-B1 Continuous method for manufacturing an acid functional blocked solid isocyanate BAYER MATERIALSCIENCE LLC (US) 2011-05-04 EP claimed
US-20070027249-A1 Water-based polyurethane-polyethylene compositions VALSPAR SOURCING, INC. (US) 2007-02-01 US claimed
US-20240101752-A1 SILICONE URETHANE (METH)ACRYLATES AND THEIR USE IN 3D PRINTING RESINS AND COATING COMPOSITIONS EVONIK OPERATIONS GMBH (DE) 2024-03-28 US disclosed
US-11667768-B2 Polyisocyanate compositions VENCOREX FRANCE (FR) 2023-06-06 US disclosed
CN-113088184-B High temperature resistant powder coating compositions and articles 威士伯涂料(上海)有限公司 2022-07-22 CN disclosed
US-11168192-B2 Foamable polyamide composition and foam obtained therefrom BASF SE (DE) 2021-11-09 US disclosed
EP-3762452-A1 NEW POLYISOCYANATE COMPOSITIONS Vencorex France (FR) 2021-01-13 EP disclosed
WO-1996026969-A1 COATING COMPOSITION BASED ON A BINDER CONTAINING HYDROXYL GROUPS, AND ITS USE IN PROCESSES FOR THE PRODUCTION OF COATINGS BASF CORPORATION (US) 1996-09-06 WO disclosed
EP-0571187-A1 Aqueous surface coating composition Nippon Paint Co., Ltd. (JP) 1993-11-24 EP disclosed
EP-0157291-B1 AQUEOUS POLYESTER-BASED DISPERSION, PROCESS FOR ITS PREPARATION AND ITS USE IN PREPARING STOVING ENAMELS BAYER AG (DE) 1989-07-19 EP disclosed
EP-0104424-B1 USE OF BLOCKED POLYISOCYANATES AS CURING AGENTS FOR BINDERS CONTAINING HYDROXYL GROUPS BAYER AG (DE) 1988-06-15 EP disclosed
US-4594374-A Process for the production of aqueous dispersions and use thereof for the production of metal effect lacquer coatings BAYER AKTIENGESELLSCHAFT (DE) 1986-06-10 US disclosed
EP-0104424-A2 Use of blocked polyisocyanates as curing agents for binders containing hydroxyl groups BAYER AG (DE) 1984-04-04 EP disclosed